beta-gentiobiose
SMILES | C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)O)O)O)O)O)O)O)O |
InChIKey | DLRVVLDZNNYCBX-LIZSDCNHSA-N |
Chemical properties
Hydrogen bond acceptors | 11 |
Hydrogen bond donors | 8 |
Rotatable bonds | 4 |
Molecular weight (Da) | 342.1 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
β1 | B0FL73 | Guinea pig | Adrenoceptors | A | pEC50 | 8.7 | 8.7 | 8.7 | ChEMBL |
β1 | ADRB1 | Human | Adrenoceptors | A | pEC50 | 6.3 | 6.3 | 6.3 | ChEMBL |
β3 | ADRB3 | Human | Adrenoceptors | A | pEC50 | 5.9 | 5.9 | 5.9 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pEC50 | 9.3 | 9.3 | 9.3 | ChEMBL |